4-[(3-fluorophenyl)methyl]-N-(4-methoxyphenyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[(3-fluorophenyl)methyl]-N-(4-methoxyphenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-[(3-fluorophenyl)methyl]-N-(4-methoxyphenyl)piperazin-4-ium-1-carboxamide CAS Name: 4-[(3-fluorophenyl)methyl]-N-(4-methoxyphenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[(3-fluorophenyl)methyl]-N-(4-methoxyphenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-(3-fluorobenzyl)-N-(4-methoxyphenyl)piperazin-4-ium-1-carboxamide Formula: C19H23FN3O2+ MolecularWeight: 344.403223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C19H22FN3O2/c1-25-18-7-5-17(6-8-18)21-19(24)23-11-9-22(10-12-23)14-15-3-2-4-16(20)13-15/h2-8,13H,9-12,14H2,1H3,(H,21,24)/p+1